(6-methyl-2-phenyl-chromen-4-ylidene)-[4-(phenylcarbonyloxy)phenyl]azanium tetrafluoroborate

Systemtic Name: (6-methyl-2-phenyl-chromen-4-ylidene)-[4-(phenylcarbonyloxy)phenyl]azanium tetrafluoroborate Openeye Name: (4-benzoyloxyphenyl)-(6-methyl-2-phenyl-chromen-4-ylidene)ammonium tetrafluoroborate CAS Name: (4-benzoyloxyphenyl)-(6-methyl-2-phenyl-1-benzopyran-4-ylidene)ammonium tetrafluoroborate IUPAC Name: (4-benzoyloxyphenyl)-(6-methyl-2-phenylchromen-4-ylidene)azanium tetrafluoroborate Traditional Name: (4-benzoyloxyphenyl)-(6-methyl-2-phenyl-chromen-4-ylidene)ammonium tetrafluoroborate Formula: C29H22BF4NO3 MolecularWeight: 519.294493

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC1=CC2=C(C=C1)OC(=CC2=[NH+]C3=CC=C(C=C3)OC(=O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

[B-](F)(F)(F)F.CC1=CC2=C(C=C1)OC(=CC2=[NH+]C3=CC=C(C=C3)OC(=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H21NO3.BF4/c1-20-12-17-27-25(18-20)26(19-28(33-27)21-8-4-2-5-9-21)30-23-13-15-24(16-14-23)32-29(31)22-10-6-3-7-11-22;2-1(3,4)5/h2-19H,1H3;/q;-1/p+1